N-(6-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-4-phenylsulfanyl-butanamide

Systemtic Name: N-(6-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-4-phenylsulfanyl-butanamide Openeye Name: N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-furylmethyl)-4-phenylsulfanyl-butanamide CAS Name: N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-furanylmethyl)-4-(phenylthio)butanamide IUPAC Name: N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-4-phenylsulfanylbutanamide Traditional Name: N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-furfuryl)-4-(phenylthio)butyramide Formula: C23H21ClN2O2S2 MolecularWeight: 457.00804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1N=C(S2)N(CC3=CC=CO3)C(=O)CCCSC4=CC=CC=C4)Cl

Isomeric SMILES

CC1=CC(=CC2=C1N=C(S2)N(CC3=CC=CO3)C(=O)CCCSC4=CC=CC=C4)Cl

InChI

InChI=1S/C23H21ClN2O2S2/c1-16-13-17(24)14-20-22(16)25-23(30-20)26(15-18-7-5-11-28-18)21(27)10-6-12-29-19-8-3-2-4-9-19/h2-5,7-9,11,13-14H,6,10,12,15H2,1H3